Vitas-M small molecule compound

2-chloro-9-methyl-3-{(Z)-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK534484
SMILES S=C1S/C(=C\c2c(Cl)nc3n(c2=O)cccc3C)/C(=O)N1CCc1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H16ClN3O2S2 MW 441.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O2S2/c1-13-6-5-10-24-18(13)23-17(22)15(19(24)26)12-16-20(27)25(21(28)29-16)11-9-14-7-3-2-4-8-14/h2-8,10,12H,9,11H2,1H3/b16-12-
InChIKey
IEAZILZEGJBHQJ-VBKFSLOCSA-N
Synonyms
373371-80-3
(5Z)5((2chloro9methyl4oxopyrido(12a)pyrimidin3yl)methylidene)3(2phenylethyl)2sulfanylidene13thiazolidin4one
(5Z)5((2CHLORO9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PHENETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2chloro9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3phenethyl2thioxothiazolidin4one
2chloro9methyl3((Z)(4oxo3(2phenylethyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
373371803
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)Cl
InChI=1SC21H16ClN3O2S2c11365102418(13)2317(22)15(19(24)26)121620(27)25(21(28)2916)119147324814h281012H911H21H3b1612
MFCD01946074
S=C1SC(=Cc2c(Cl)nc3n(c2=O)cccc3C)C(=O)N1CCc1ccccc1
ZINC000013403861
ZINC13403861

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Available files

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